methyl 4-[6-azanyl-1-(3-chlorophenyl)-5-cyano-3-methyl-4H-pyrano[2,3-c]pyrazol-4-yl]benzoate

Systemtic Name: methyl 4-[6-azanyl-1-(3-chlorophenyl)-5-cyano-3-methyl-4H-pyrano[2,3-c]pyrazol-4-yl]benzoate Openeye Name: methyl 4-[6-amino-1-(3-chlorophenyl)-5-cyano-3-methyl-4H-pyrano[2,3-c]pyrazol-4-yl]benzoate CAS Name: 4-[6-amino-1-(3-chlorophenyl)-5-cyano-3-methyl-4H-pyrano[2,3-c]pyrazol-4-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[6-amino-1-(3-chlorophenyl)-5-cyano-3-methyl-4H-pyrano[2,3-c]pyrazol-4-yl]benzoate Traditional Name: 4-[6-amino-1-(3-chlorophenyl)-5-cyano-3-methyl-4H-pyrano[2,3-c]pyrazol-4-yl]benzoic acid methyl ester Formula: C22H17ClN4O3 MolecularWeight: 420.84838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CC=C(C=C3)C(=O)OC)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CC=C(C=C3)C(=O)OC)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H17ClN4O3/c1-12-18-19(13-6-8-14(9-7-13)22(28)29-2)17(11-24)20(25)30-21(18)27(26-12)16-5-3-4-15(23)10-16/h3-10,19H,25H2,1-2H3